USER MOD reduce.3.24.130724 H: found=0, std=0, add=517, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 517 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 237 HIS : no HD1:sc= -0.325 K(o=-0.77,f=-3.1!) USER MOD Set 1.2: A 239 ASN : amide:sc= -0.447 K(o=-0.77,f=-3) USER MOD Single : A 232 TYR OH : rot 180:sc= 0 USER MOD Single : A 235 SER OG : rot 180:sc= 0 USER MOD Single : A 241 THR OG1 : rot 180:sc= 0 USER MOD Single : A 244 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 254 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 257 ASN : amide:sc= -0.0464 X(o=-0.046,f=-0.5) USER MOD Single : A 261 MET CE :methyl 142:sc= -0.164 (180deg=-2.55!) USER MOD Single : A 272 TYR OH : rot 180:sc= -0.28 USER MOD Single : A 276 THR OG1 : rot 180:sc= 0 USER MOD Single : A 278 SER OG : rot 170:sc= -0.434 USER MOD Single : A 280 SER OG : rot 180:sc= -0.0124 USER MOD Single : A 282 CYS SG : rot 180:sc=-0.00451 USER MOD Single : A 289 GLN : amide:sc= -0.499 K(o=-0.5,f=-1.1) USER MOD Single : A 291 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 300 MET CE :methyl -175:sc=-0.00484 (180deg=-0.0436) USER MOD Single : A 304 HIS : no HD1:sc= -3.24! C(o=-3.2!,f=-3.2!) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 230 6.970 4.646 1.045 1.00 0.00 N ATOM 60 CA GLY A 230 5.964 4.422 0.023 1.00 0.00 C ATOM 61 C GLY A 230 5.493 2.982 -0.020 1.00 0.00 C ATOM 62 O GLY A 230 6.304 2.055 -0.039 1.00 0.00 O ATOM 0 HA2 GLY A 230 5.111 5.075 0.208 1.00 0.00 H new ATOM 0 HA3 GLY A 230 6.371 4.697 -0.950 1.00 0.00 H new ATOM 66 N LEU A 231 4.178 2.792 -0.033 1.00 0.00 N ATOM 67 CA LEU A 231 3.599 1.454 -0.072 1.00 0.00 C ATOM 68 C LEU A 231 2.764 1.258 -1.334 1.00 0.00 C ATOM 69 O LEU A 231 2.141 2.197 -1.830 1.00 0.00 O ATOM 70 CB LEU A 231 2.734 1.214 1.167 1.00 0.00 C ATOM 71 CG LEU A 231 3.485 0.861 2.451 1.00 0.00 C ATOM 72 CD1 LEU A 231 2.553 0.930 3.651 1.00 0.00 C ATOM 73 CD2 LEU A 231 4.112 -0.521 2.340 1.00 0.00 C ATOM 0 H LEU A 231 3.493 3.548 -0.017 1.00 0.00 H new ATOM 0 HA LEU A 231 4.416 0.732 -0.083 1.00 0.00 H new ATOM 0 HB2 LEU A 231 2.141 2.110 1.351 1.00 0.00 H new ATOM 0 HB3 LEU A 231 2.034 0.408 0.946 1.00 0.00 H new ATOM 0 HG LEU A 231 4.283 1.590 2.594 1.00 0.00 H new ATOM 0 HD11 LEU A 231 3.105 0.676 4.556 1.00 0.00 H new ATOM 0 HD12 LEU A 231 2.152 1.939 3.743 1.00 0.00 H new ATOM 0 HD13 LEU A 231 1.733 0.225 3.516 1.00 0.00 H new ATOM 0 HD21 LEU A 231 4.642 -0.755 3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 231 3.331 -1.262 2.172 1.00 0.00 H new ATOM 0 HD23 LEU A 231 4.813 -0.537 1.505 1.00 0.00 H new ATOM 85 N TYR A 232 2.755 0.033 -1.847 1.00 0.00 N ATOM 86 CA TYR A 232 1.997 -0.286 -3.051 1.00 0.00 C ATOM 87 C TYR A 232 0.932 -1.339 -2.761 1.00 0.00 C ATOM 88 O TYR A 232 1.162 -2.278 -1.999 1.00 0.00 O ATOM 89 CB TYR A 232 2.934 -0.782 -4.153 1.00 0.00 C ATOM 90 CG TYR A 232 2.228 -1.545 -5.250 1.00 0.00 C ATOM 91 CD1 TYR A 232 1.641 -2.779 -4.999 1.00 0.00 C ATOM 92 CD2 TYR A 232 2.148 -1.032 -6.539 1.00 0.00 C ATOM 93 CE1 TYR A 232 0.996 -3.480 -5.999 1.00 0.00 C ATOM 94 CE2 TYR A 232 1.503 -1.725 -7.545 1.00 0.00 C ATOM 95 CZ TYR A 232 0.929 -2.949 -7.270 1.00 0.00 C ATOM 96 OH TYR A 232 0.286 -3.644 -8.269 1.00 0.00 O ATOM 0 H TYR A 232 3.264 -0.756 -1.448 1.00 0.00 H new ATOM 0 HA TYR A 232 1.500 0.624 -3.388 1.00 0.00 H new ATOM 0 HB2 TYR A 232 3.451 0.072 -4.591 1.00 0.00 H new ATOM 0 HB3 TYR A 232 3.696 -1.422 -3.709 1.00 0.00 H new ATOM 0 HD1 TYR A 232 1.690 -3.197 -4.005 1.00 0.00 H new ATOM 0 HD2 TYR A 232 2.598 -0.075 -6.758 1.00 0.00 H new ATOM 0 HE1 TYR A 232 0.547 -4.439 -5.787 1.00 0.00 H new ATOM 0 HE2 TYR A 232 1.448 -1.311 -8.541 1.00 0.00 H new ATOM 0 HH TYR A 232 0.328 -3.131 -9.103 1.00 0.00 H new ATOM 106 N VAL A 233 -0.235 -1.176 -3.376 1.00 0.00 N ATOM 107 CA VAL A 233 -1.336 -2.113 -3.187 1.00 0.00 C ATOM 108 C VAL A 233 -1.797 -2.696 -4.519 1.00 0.00 C ATOM 109 O VAL A 233 -2.014 -1.966 -5.486 1.00 0.00 O ATOM 110 CB VAL A 233 -2.534 -1.438 -2.493 1.00 0.00 C ATOM 111 CG1 VAL A 233 -3.143 -0.374 -3.392 1.00 0.00 C ATOM 112 CG2 VAL A 233 -3.576 -2.476 -2.101 1.00 0.00 C ATOM 0 H VAL A 233 -0.442 -0.404 -4.009 1.00 0.00 H new ATOM 0 HA VAL A 233 -0.962 -2.916 -2.552 1.00 0.00 H new ATOM 0 HB VAL A 233 -2.178 -0.951 -1.585 1.00 0.00 H new ATOM 0 HG11 VAL A 233 -3.988 0.091 -2.884 1.00 0.00 H new ATOM 0 HG12 VAL A 233 -2.393 0.384 -3.618 1.00 0.00 H new ATOM 0 HG13 VAL A 233 -3.485 -0.834 -4.319 1.00 0.00 H new ATOM 0 HG21 VAL A 233 -4.416 -1.982 -1.612 1.00 0.00 H new ATOM 0 HG22 VAL A 233 -3.929 -2.992 -2.994 1.00 0.00 H new ATOM 0 HG23 VAL A 233 -3.131 -3.198 -1.416 1.00 0.00 H new ATOM 122 N GLY A 234 -1.946 -4.016 -4.561 1.00 0.00 N ATOM 123 CA GLY A 234 -2.380 -4.675 -5.779 1.00 0.00 C ATOM 124 C GLY A 234 -3.417 -5.750 -5.519 1.00 0.00 C ATOM 125 O GLY A 234 -3.618 -6.164 -4.377 1.00 0.00 O ATOM 0 H GLY A 234 -1.774 -4.641 -3.773 1.00 0.00 H new ATOM 0 HA2 GLY A 234 -2.794 -3.933 -6.462 1.00 0.00 H new ATOM 0 HA3 GLY A 234 -1.517 -5.119 -6.275 1.00 0.00 H new ATOM 129 N SER A 235 -4.079 -6.201 -6.579 1.00 0.00 N ATOM 130 CA SER A 235 -5.105 -7.231 -6.459 1.00 0.00 C ATOM 131 C SER A 235 -6.265 -6.743 -5.597 1.00 0.00 C ATOM 132 O SER A 235 -6.694 -7.428 -4.668 1.00 0.00 O ATOM 133 CB SER A 235 -4.509 -8.506 -5.859 1.00 0.00 C ATOM 134 OG SER A 235 -3.622 -9.132 -6.770 1.00 0.00 O ATOM 0 H SER A 235 -3.924 -5.870 -7.531 1.00 0.00 H new ATOM 0 HA SER A 235 -5.484 -7.451 -7.457 1.00 0.00 H new ATOM 0 HB2 SER A 235 -3.979 -8.265 -4.938 1.00 0.00 H new ATOM 0 HB3 SER A 235 -5.310 -9.196 -5.594 1.00 0.00 H new ATOM 0 HG SER A 235 -3.253 -9.943 -6.362 1.00 0.00 H new ATOM 140 N LEU A 236 -6.769 -5.555 -5.912 1.00 0.00 N ATOM 141 CA LEU A 236 -7.880 -4.973 -5.167 1.00 0.00 C ATOM 142 C LEU A 236 -9.183 -5.094 -5.951 1.00 0.00 C ATOM 143 O LEU A 236 -9.223 -5.704 -7.020 1.00 0.00 O ATOM 144 CB LEU A 236 -7.595 -3.504 -4.852 1.00 0.00 C ATOM 145 CG LEU A 236 -6.351 -3.228 -4.007 1.00 0.00 C ATOM 146 CD1 LEU A 236 -6.024 -1.742 -4.008 1.00 0.00 C ATOM 147 CD2 LEU A 236 -6.550 -3.731 -2.584 1.00 0.00 C ATOM 0 H LEU A 236 -6.426 -4.976 -6.678 1.00 0.00 H new ATOM 0 HA LEU A 236 -7.987 -5.524 -4.232 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -7.497 -2.964 -5.794 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -8.460 -3.090 -4.335 1.00 0.00 H new ATOM 0 HG LEU A 236 -5.510 -3.765 -4.447 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -5.136 -1.564 -3.402 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -5.838 -1.411 -5.030 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -6.864 -1.184 -3.593 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -5.655 -3.526 -1.997 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -7.403 -3.223 -2.134 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -6.735 -4.805 -2.600 1.00 0.00 H new ATOM 159 N HIS A 237 -10.248 -4.507 -5.413 1.00 0.00 N ATOM 160 CA HIS A 237 -11.553 -4.546 -6.064 1.00 0.00 C ATOM 161 C HIS A 237 -11.940 -3.166 -6.587 1.00 0.00 C ATOM 162 O HIS A 237 -11.666 -2.149 -5.949 1.00 0.00 O ATOM 163 CB HIS A 237 -12.617 -5.052 -5.089 1.00 0.00 C ATOM 164 CG HIS A 237 -13.782 -5.708 -5.763 1.00 0.00 C ATOM 165 ND1 HIS A 237 -14.866 -5.004 -6.247 1.00 0.00 N ATOM 166 CD2 HIS A 237 -14.030 -7.010 -6.035 1.00 0.00 C ATOM 167 CE1 HIS A 237 -15.730 -5.846 -6.785 1.00 0.00 C ATOM 168 NE2 HIS A 237 -15.246 -7.070 -6.670 1.00 0.00 N ATOM 0 H HIS A 237 -10.233 -3.999 -4.529 1.00 0.00 H new ATOM 0 HA HIS A 237 -11.490 -5.231 -6.909 1.00 0.00 H new ATOM 0 HB2 HIS A 237 -12.159 -5.762 -4.400 1.00 0.00 H new ATOM 0 HB3 HIS A 237 -12.978 -4.215 -4.491 1.00 0.00 H new ATOM 0 HD2 HIS A 237 -13.390 -7.847 -5.797 1.00 0.00 H new ATOM 0 HE1 HIS A 237 -16.672 -5.579 -7.241 1.00 0.00 H new ATOM 0 HE2 HIS A 237 -15.702 -7.921 -6.999 1.00 0.00 H new ATOM 176 N PHE A 238 -12.579 -3.138 -7.752 1.00 0.00 N ATOM 177 CA PHE A 238 -13.002 -1.883 -8.362 1.00 0.00 C ATOM 178 C PHE A 238 -13.751 -1.015 -7.355 1.00 0.00 C ATOM 179 O PHE A 238 -13.518 0.190 -7.265 1.00 0.00 O ATOM 180 CB PHE A 238 -13.891 -2.157 -9.577 1.00 0.00 C ATOM 181 CG PHE A 238 -14.863 -1.050 -9.870 1.00 0.00 C ATOM 182 CD1 PHE A 238 -14.411 0.215 -10.209 1.00 0.00 C ATOM 183 CD2 PHE A 238 -16.229 -1.275 -9.807 1.00 0.00 C ATOM 184 CE1 PHE A 238 -15.304 1.235 -10.479 1.00 0.00 C ATOM 185 CE2 PHE A 238 -17.126 -0.258 -10.075 1.00 0.00 C ATOM 186 CZ PHE A 238 -16.663 0.998 -10.413 1.00 0.00 C ATOM 0 H PHE A 238 -12.815 -3.970 -8.292 1.00 0.00 H new ATOM 0 HA PHE A 238 -12.111 -1.346 -8.686 1.00 0.00 H new ATOM 0 HB2 PHE A 238 -13.259 -2.316 -10.451 1.00 0.00 H new ATOM 0 HB3 PHE A 238 -14.444 -3.081 -9.411 1.00 0.00 H new ATOM 0 HD1 PHE A 238 -13.349 0.406 -10.263 1.00 0.00 H new ATOM 0 HD2 PHE A 238 -16.597 -2.256 -9.546 1.00 0.00 H new ATOM 0 HE1 PHE A 238 -14.939 2.217 -10.741 1.00 0.00 H new ATOM 0 HE2 PHE A 238 -18.188 -0.446 -10.020 1.00 0.00 H new ATOM 0 HZ PHE A 238 -17.362 1.793 -10.625 1.00 0.00 H new ATOM 196 N ASN A 239 -14.652 -1.636 -6.601 1.00 0.00 N ATOM 197 CA ASN A 239 -15.436 -0.921 -5.601 1.00 0.00 C ATOM 198 C ASN A 239 -14.530 -0.127 -4.665 1.00 0.00 C ATOM 199 O ASN A 239 -14.897 0.951 -4.196 1.00 0.00 O ATOM 200 CB ASN A 239 -16.290 -1.902 -4.795 1.00 0.00 C ATOM 201 CG ASN A 239 -17.393 -2.527 -5.626 1.00 0.00 C ATOM 202 OD1 ASN A 239 -17.470 -3.749 -5.757 1.00 0.00 O ATOM 203 ND2 ASN A 239 -18.254 -1.690 -6.192 1.00 0.00 N ATOM 0 H ASN A 239 -14.857 -2.633 -6.664 1.00 0.00 H new ATOM 0 HA ASN A 239 -16.092 -0.222 -6.121 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -15.652 -2.689 -4.392 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -16.730 -1.382 -3.944 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -19.018 -2.053 -6.763 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -18.152 -0.684 -6.056 1.00 0.00 H new ATOM 210 N ILE A 240 -13.347 -0.669 -4.397 1.00 0.00 N ATOM 211 CA ILE A 240 -12.388 -0.011 -3.518 1.00 0.00 C ATOM 212 C ILE A 240 -12.047 1.387 -4.024 1.00 0.00 C ATOM 213 O ILE A 240 -11.635 1.560 -5.172 1.00 0.00 O ATOM 214 CB ILE A 240 -11.090 -0.829 -3.388 1.00 0.00 C ATOM 215 CG1 ILE A 240 -11.394 -2.227 -2.846 1.00 0.00 C ATOM 216 CG2 ILE A 240 -10.098 -0.110 -2.486 1.00 0.00 C ATOM 217 CD1 ILE A 240 -11.627 -2.258 -1.352 1.00 0.00 C ATOM 0 H ILE A 240 -13.030 -1.561 -4.776 1.00 0.00 H new ATOM 0 HA ILE A 240 -12.859 0.065 -2.538 1.00 0.00 H new ATOM 0 HB ILE A 240 -10.643 -0.932 -4.377 1.00 0.00 H new ATOM 0 HG12 ILE A 240 -12.276 -2.620 -3.351 1.00 0.00 H new ATOM 0 HG13 ILE A 240 -10.565 -2.891 -3.090 1.00 0.00 H new ATOM 0 HG21 ILE A 240 -9.186 -0.701 -2.404 1.00 0.00 H new ATOM 0 HG22 ILE A 240 -9.861 0.866 -2.910 1.00 0.00 H new ATOM 0 HG23 ILE A 240 -10.535 0.021 -1.496 1.00 0.00 H new ATOM 0 HD11 ILE A 240 -11.837 -3.280 -1.038 1.00 0.00 H new ATOM 0 HD12 ILE A 240 -10.737 -1.895 -0.837 1.00 0.00 H new ATOM 0 HD13 ILE A 240 -12.475 -1.620 -1.103 1.00 0.00 H new ATOM 229 N THR A 241 -12.218 2.382 -3.160 1.00 0.00 N ATOM 230 CA THR A 241 -11.928 3.764 -3.518 1.00 0.00 C ATOM 231 C THR A 241 -10.808 4.333 -2.654 1.00 0.00 C ATOM 232 O THR A 241 -10.289 3.653 -1.770 1.00 0.00 O ATOM 233 CB THR A 241 -13.175 4.656 -3.374 1.00 0.00 C ATOM 234 OG1 THR A 241 -13.734 4.508 -2.064 1.00 0.00 O ATOM 235 CG2 THR A 241 -14.220 4.298 -4.420 1.00 0.00 C ATOM 0 H THR A 241 -12.556 2.256 -2.206 1.00 0.00 H new ATOM 0 HA THR A 241 -11.612 3.760 -4.561 1.00 0.00 H new ATOM 0 HB THR A 241 -12.873 5.692 -3.525 1.00 0.00 H new ATOM 0 HG1 THR A 241 -14.526 5.080 -1.980 1.00 0.00 H new ATOM 0 HG21 THR A 241 -15.092 4.941 -4.299 1.00 0.00 H new ATOM 0 HG22 THR A 241 -13.801 4.439 -5.416 1.00 0.00 H new ATOM 0 HG23 THR A 241 -14.517 3.257 -4.296 1.00 0.00 H new ATOM 243 N GLU A 242 -10.442 5.584 -2.916 1.00 0.00 N ATOM 244 CA GLU A 242 -9.383 6.243 -2.161 1.00 0.00 C ATOM 245 C GLU A 242 -9.744 6.332 -0.681 1.00 0.00 C ATOM 246 O GLU A 242 -8.882 6.201 0.188 1.00 0.00 O ATOM 247 CB GLU A 242 -9.124 7.644 -2.719 1.00 0.00 C ATOM 248 CG GLU A 242 -8.756 7.653 -4.194 1.00 0.00 C ATOM 249 CD GLU A 242 -9.969 7.773 -5.096 1.00 0.00 C ATOM 250 OE1 GLU A 242 -10.671 6.757 -5.283 1.00 0.00 O ATOM 251 OE2 GLU A 242 -10.215 8.881 -5.616 1.00 0.00 O ATOM 0 H GLU A 242 -10.863 6.161 -3.645 1.00 0.00 H new ATOM 0 HA GLU A 242 -8.476 5.647 -2.261 1.00 0.00 H new ATOM 0 HB2 GLU A 242 -10.014 8.255 -2.572 1.00 0.00 H new ATOM 0 HB3 GLU A 242 -8.320 8.110 -2.150 1.00 0.00 H new ATOM 0 HG2 GLU A 242 -8.078 8.483 -4.391 1.00 0.00 H new ATOM 0 HG3 GLU A 242 -8.217 6.737 -4.436 1.00 0.00 H new ATOM 258 N ASP A 243 -11.023 6.555 -0.403 1.00 0.00 N ATOM 259 CA ASP A 243 -11.500 6.662 0.971 1.00 0.00 C ATOM 260 C ASP A 243 -11.241 5.368 1.737 1.00 0.00 C ATOM 261 O ASP A 243 -10.962 5.391 2.936 1.00 0.00 O ATOM 262 CB ASP A 243 -12.994 6.990 0.991 1.00 0.00 C ATOM 263 CG ASP A 243 -13.436 7.595 2.309 1.00 0.00 C ATOM 264 OD1 ASP A 243 -13.260 6.934 3.353 1.00 0.00 O ATOM 265 OD2 ASP A 243 -13.959 8.729 2.296 1.00 0.00 O ATOM 0 H ASP A 243 -11.749 6.665 -1.111 1.00 0.00 H new ATOM 0 HA ASP A 243 -10.952 7.469 1.458 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -13.222 7.684 0.182 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -13.565 6.081 0.802 1.00 0.00 H new ATOM 270 N MET A 244 -11.335 4.242 1.038 1.00 0.00 N ATOM 271 CA MET A 244 -11.111 2.940 1.653 1.00 0.00 C ATOM 272 C MET A 244 -9.631 2.731 1.960 1.00 0.00 C ATOM 273 O MET A 244 -9.272 2.233 3.028 1.00 0.00 O ATOM 274 CB MET A 244 -11.615 1.824 0.735 1.00 0.00 C ATOM 275 CG MET A 244 -13.095 1.932 0.406 1.00 0.00 C ATOM 276 SD MET A 244 -13.843 0.332 0.042 1.00 0.00 S ATOM 277 CE MET A 244 -15.522 0.823 -0.343 1.00 0.00 C ATOM 0 H MET A 244 -11.565 4.205 0.045 1.00 0.00 H new ATOM 0 HA MET A 244 -11.667 2.909 2.590 1.00 0.00 H new ATOM 0 HB2 MET A 244 -11.043 1.841 -0.192 1.00 0.00 H new ATOM 0 HB3 MET A 244 -11.426 0.861 1.209 1.00 0.00 H new ATOM 0 HG2 MET A 244 -13.618 2.391 1.245 1.00 0.00 H new ATOM 0 HG3 MET A 244 -13.226 2.593 -0.451 1.00 0.00 H new ATOM 0 HE1 MET A 244 -16.112 -0.060 -0.590 1.00 0.00 H new ATOM 0 HE2 MET A 244 -15.962 1.323 0.520 1.00 0.00 H new ATOM 0 HE3 MET A 244 -15.516 1.505 -1.194 1.00 0.00 H new ATOM 287 N LEU A 245 -8.777 3.115 1.018 1.00 0.00 N ATOM 288 CA LEU A 245 -7.335 2.970 1.188 1.00 0.00 C ATOM 289 C LEU A 245 -6.822 3.884 2.297 1.00 0.00 C ATOM 290 O LEU A 245 -6.003 3.478 3.120 1.00 0.00 O ATOM 291 CB LEU A 245 -6.613 3.286 -0.123 1.00 0.00 C ATOM 292 CG LEU A 245 -6.708 2.220 -1.215 1.00 0.00 C ATOM 293 CD1 LEU A 245 -6.089 2.725 -2.509 1.00 0.00 C ATOM 294 CD2 LEU A 245 -6.032 0.933 -0.765 1.00 0.00 C ATOM 0 H LEU A 245 -9.057 3.529 0.129 1.00 0.00 H new ATOM 0 HA LEU A 245 -7.130 1.937 1.470 1.00 0.00 H new ATOM 0 HB2 LEU A 245 -7.013 4.220 -0.519 1.00 0.00 H new ATOM 0 HB3 LEU A 245 -5.560 3.458 0.098 1.00 0.00 H new ATOM 0 HG LEU A 245 -7.761 2.008 -1.398 1.00 0.00 H new ATOM 0 HD11 LEU A 245 -6.166 1.953 -3.275 1.00 0.00 H new ATOM 0 HD12 LEU A 245 -6.618 3.619 -2.841 1.00 0.00 H new ATOM 0 HD13 LEU A 245 -5.039 2.966 -2.341 1.00 0.00 H new ATOM 0 HD21 LEU A 245 -6.110 0.186 -1.555 1.00 0.00 H new ATOM 0 HD22 LEU A 245 -4.981 1.129 -0.553 1.00 0.00 H new ATOM 0 HD23 LEU A 245 -6.521 0.561 0.136 1.00 0.00 H new ATOM 306 N ARG A 246 -7.313 5.119 2.312 1.00 0.00 N ATOM 307 CA ARG A 246 -6.905 6.090 3.321 1.00 0.00 C ATOM 308 C ARG A 246 -7.381 5.666 4.707 1.00 0.00 C ATOM 309 O ARG A 246 -6.670 5.834 5.697 1.00 0.00 O ATOM 310 CB ARG A 246 -7.461 7.474 2.980 1.00 0.00 C ATOM 311 CG ARG A 246 -8.828 7.748 3.585 1.00 0.00 C ATOM 312 CD ARG A 246 -9.551 8.863 2.846 1.00 0.00 C ATOM 313 NE ARG A 246 -9.032 10.181 3.200 1.00 0.00 N ATOM 314 CZ ARG A 246 -9.673 11.316 2.944 1.00 0.00 C ATOM 315 NH1 ARG A 246 -10.850 11.294 2.335 1.00 0.00 N ATOM 316 NH2 ARG A 246 -9.135 12.477 3.297 1.00 0.00 N ATOM 0 H ARG A 246 -7.993 5.471 1.638 1.00 0.00 H new ATOM 0 HA ARG A 246 -5.816 6.135 3.328 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -6.761 8.233 3.328 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -7.526 7.573 1.896 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -9.430 6.840 3.554 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -8.715 8.019 4.635 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -9.450 8.710 1.771 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -10.616 8.819 3.076 1.00 0.00 H new ATOM 0 HE ARG A 246 -8.128 10.233 3.669 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -11.266 10.404 2.061 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -11.340 12.167 2.140 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -8.229 12.498 3.765 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -9.628 13.348 3.100 1.00 0.00 H new ATOM 330 N GLY A 247 -8.590 5.117 4.770 1.00 0.00 N ATOM 331 CA GLY A 247 -9.141 4.678 6.039 1.00 0.00 C ATOM 332 C GLY A 247 -8.377 3.509 6.630 1.00 0.00 C ATOM 333 O GLY A 247 -8.205 3.422 7.846 1.00 0.00 O ATOM 0 H GLY A 247 -9.198 4.968 3.965 1.00 0.00 H new ATOM 0 HA2 GLY A 247 -9.129 5.509 6.744 1.00 0.00 H new ATOM 0 HA3 GLY A 247 -10.184 4.393 5.900 1.00 0.00 H new ATOM 337 N ILE A 248 -7.919 2.608 5.768 1.00 0.00 N ATOM 338 CA ILE A 248 -7.170 1.439 6.211 1.00 0.00 C ATOM 339 C ILE A 248 -5.723 1.800 6.528 1.00 0.00 C ATOM 340 O ILE A 248 -5.171 1.369 7.540 1.00 0.00 O ATOM 341 CB ILE A 248 -7.189 0.322 5.150 1.00 0.00 C ATOM 342 CG1 ILE A 248 -8.626 -0.122 4.871 1.00 0.00 C ATOM 343 CG2 ILE A 248 -6.343 -0.857 5.607 1.00 0.00 C ATOM 344 CD1 ILE A 248 -8.753 -1.041 3.676 1.00 0.00 C ATOM 0 H ILE A 248 -8.054 2.665 4.759 1.00 0.00 H new ATOM 0 HA ILE A 248 -7.658 1.077 7.116 1.00 0.00 H new ATOM 0 HB ILE A 248 -6.764 0.712 4.225 1.00 0.00 H new ATOM 0 HG12 ILE A 248 -9.019 -0.629 5.752 1.00 0.00 H new ATOM 0 HG13 ILE A 248 -9.245 0.760 4.708 1.00 0.00 H new ATOM 0 HG21 ILE A 248 -6.366 -1.638 4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 248 -5.315 -0.530 5.759 1.00 0.00 H new ATOM 0 HG23 ILE A 248 -6.741 -1.249 6.543 1.00 0.00 H new ATOM 0 HD11 ILE A 248 -9.799 -1.316 3.538 1.00 0.00 H new ATOM 0 HD12 ILE A 248 -8.391 -0.530 2.784 1.00 0.00 H new ATOM 0 HD13 ILE A 248 -8.161 -1.941 3.844 1.00 0.00 H new ATOM 356 N PHE A 249 -5.113 2.596 5.655 1.00 0.00 N ATOM 357 CA PHE A 249 -3.730 3.017 5.842 1.00 0.00 C ATOM 358 C PHE A 249 -3.645 4.196 6.807 1.00 0.00 C ATOM 359 O PHE A 249 -2.555 4.643 7.162 1.00 0.00 O ATOM 360 CB PHE A 249 -3.104 3.397 4.498 1.00 0.00 C ATOM 361 CG PHE A 249 -2.890 2.225 3.584 1.00 0.00 C ATOM 362 CD1 PHE A 249 -3.948 1.404 3.228 1.00 0.00 C ATOM 363 CD2 PHE A 249 -1.630 1.944 3.080 1.00 0.00 C ATOM 364 CE1 PHE A 249 -3.753 0.324 2.388 1.00 0.00 C ATOM 365 CE2 PHE A 249 -1.429 0.866 2.239 1.00 0.00 C ATOM 366 CZ PHE A 249 -2.492 0.055 1.891 1.00 0.00 C ATOM 0 H PHE A 249 -5.555 2.962 4.812 1.00 0.00 H new ATOM 0 HA PHE A 249 -3.177 2.181 6.269 1.00 0.00 H new ATOM 0 HB2 PHE A 249 -3.746 4.124 4.000 1.00 0.00 H new ATOM 0 HB3 PHE A 249 -2.147 3.887 4.678 1.00 0.00 H new ATOM 0 HD1 PHE A 249 -4.936 1.610 3.611 1.00 0.00 H new ATOM 0 HD2 PHE A 249 -0.795 2.575 3.348 1.00 0.00 H new ATOM 0 HE1 PHE A 249 -4.586 -0.309 2.120 1.00 0.00 H new ATOM 0 HE2 PHE A 249 -0.442 0.658 1.854 1.00 0.00 H new ATOM 0 HZ PHE A 249 -2.338 -0.787 1.232 1.00 0.00 H new ATOM 376 N GLU A 250 -4.804 4.694 7.226 1.00 0.00 N ATOM 377 CA GLU A 250 -4.861 5.822 8.148 1.00 0.00 C ATOM 378 C GLU A 250 -4.305 5.436 9.515 1.00 0.00 C ATOM 379 O GLU A 250 -3.334 6.014 10.005 1.00 0.00 O ATOM 380 CB GLU A 250 -6.301 6.319 8.292 1.00 0.00 C ATOM 381 CG GLU A 250 -6.621 6.864 9.674 1.00 0.00 C ATOM 382 CD GLU A 250 -5.780 8.073 10.034 1.00 0.00 C ATOM 383 OE1 GLU A 250 -4.577 8.079 9.698 1.00 0.00 O ATOM 384 OE2 GLU A 250 -6.323 9.012 10.653 1.00 0.00 O ATOM 0 H GLU A 250 -5.715 4.334 6.942 1.00 0.00 H new ATOM 0 HA GLU A 250 -4.247 6.624 7.739 1.00 0.00 H new ATOM 0 HB2 GLU A 250 -6.483 7.098 7.552 1.00 0.00 H new ATOM 0 HB3 GLU A 250 -6.984 5.500 8.067 1.00 0.00 H new ATOM 0 HG2 GLU A 250 -7.676 7.134 9.719 1.00 0.00 H new ATOM 0 HG3 GLU A 250 -6.461 6.081 10.415 1.00 0.00 H new ATOM 391 N PRO A 251 -4.935 4.435 10.148 1.00 0.00 N ATOM 392 CA PRO A 251 -4.522 3.948 11.468 1.00 0.00 C ATOM 393 C PRO A 251 -3.188 3.211 11.422 1.00 0.00 C ATOM 394 O PRO A 251 -2.714 2.699 12.436 1.00 0.00 O ATOM 395 CB PRO A 251 -5.649 2.991 11.862 1.00 0.00 C ATOM 396 CG PRO A 251 -6.231 2.537 10.567 1.00 0.00 C ATOM 397 CD PRO A 251 -6.099 3.701 9.624 1.00 0.00 C ATOM 0 HA PRO A 251 -4.371 4.764 12.175 1.00 0.00 H new ATOM 0 HB2 PRO A 251 -5.269 2.150 12.442 1.00 0.00 H new ATOM 0 HB3 PRO A 251 -6.396 3.491 12.478 1.00 0.00 H new ATOM 0 HG2 PRO A 251 -5.702 1.664 10.186 1.00 0.00 H new ATOM 0 HG3 PRO A 251 -7.275 2.249 10.688 1.00 0.00 H new ATOM 0 HD2 PRO A 251 -5.937 3.370 8.598 1.00 0.00 H new ATOM 0 HD3 PRO A 251 -6.996 4.320 9.622 1.00 0.00 H new ATOM 405 N PHE A 252 -2.585 3.160 10.238 1.00 0.00 N ATOM 406 CA PHE A 252 -1.306 2.484 10.060 1.00 0.00 C ATOM 407 C PHE A 252 -0.166 3.494 9.961 1.00 0.00 C ATOM 408 O PHE A 252 0.989 3.171 10.232 1.00 0.00 O ATOM 409 CB PHE A 252 -1.337 1.609 8.805 1.00 0.00 C ATOM 410 CG PHE A 252 -2.024 0.290 9.011 1.00 0.00 C ATOM 411 CD1 PHE A 252 -1.731 -0.494 10.116 1.00 0.00 C ATOM 412 CD2 PHE A 252 -2.962 -0.168 8.100 1.00 0.00 C ATOM 413 CE1 PHE A 252 -2.362 -1.708 10.309 1.00 0.00 C ATOM 414 CE2 PHE A 252 -3.596 -1.382 8.288 1.00 0.00 C ATOM 415 CZ PHE A 252 -3.295 -2.153 9.393 1.00 0.00 C ATOM 0 H PHE A 252 -2.962 3.579 9.388 1.00 0.00 H new ATOM 0 HA PHE A 252 -1.134 1.852 10.931 1.00 0.00 H new ATOM 0 HB2 PHE A 252 -1.842 2.152 8.006 1.00 0.00 H new ATOM 0 HB3 PHE A 252 -0.315 1.429 8.472 1.00 0.00 H new ATOM 0 HD1 PHE A 252 -1.001 -0.152 10.835 1.00 0.00 H new ATOM 0 HD2 PHE A 252 -3.201 0.430 7.233 1.00 0.00 H new ATOM 0 HE1 PHE A 252 -2.126 -2.308 11.175 1.00 0.00 H new ATOM 0 HE2 PHE A 252 -4.326 -1.727 7.571 1.00 0.00 H new ATOM 0 HZ PHE A 252 -3.788 -3.102 9.541 1.00 0.00 H new ATOM 425 N GLY A 253 -0.502 4.720 9.570 1.00 0.00 N ATOM 426 CA GLY A 253 0.503 5.759 9.441 1.00 0.00 C ATOM 427 C GLY A 253 -0.022 6.987 8.723 1.00 0.00 C ATOM 428 O GLY A 253 -1.012 6.914 7.994 1.00 0.00 O ATOM 0 H GLY A 253 -1.452 5.012 9.340 1.00 0.00 H new ATOM 0 HA2 GLY A 253 0.856 6.044 10.432 1.00 0.00 H new ATOM 0 HA3 GLY A 253 1.362 5.364 8.899 1.00 0.00 H new ATOM 432 N LYS A 254 0.642 8.119 8.928 1.00 0.00 N ATOM 433 CA LYS A 254 0.238 9.369 8.296 1.00 0.00 C ATOM 434 C LYS A 254 0.380 9.282 6.779 1.00 0.00 C ATOM 435 O LYS A 254 1.481 9.105 6.259 1.00 0.00 O ATOM 436 CB LYS A 254 1.079 10.530 8.831 1.00 0.00 C ATOM 437 CG LYS A 254 0.346 11.861 8.834 1.00 0.00 C ATOM 438 CD LYS A 254 1.281 13.011 9.171 1.00 0.00 C ATOM 439 CE LYS A 254 0.647 14.356 8.851 1.00 0.00 C ATOM 440 NZ LYS A 254 1.672 15.412 8.621 1.00 0.00 N ATOM 0 H LYS A 254 1.463 8.197 9.528 1.00 0.00 H new ATOM 0 HA LYS A 254 -0.810 9.546 8.536 1.00 0.00 H new ATOM 0 HB2 LYS A 254 1.398 10.298 9.847 1.00 0.00 H new ATOM 0 HB3 LYS A 254 1.981 10.623 8.227 1.00 0.00 H new ATOM 0 HG2 LYS A 254 -0.105 12.032 7.856 1.00 0.00 H new ATOM 0 HG3 LYS A 254 -0.468 11.828 9.559 1.00 0.00 H new ATOM 0 HD2 LYS A 254 1.541 12.972 10.229 1.00 0.00 H new ATOM 0 HD3 LYS A 254 2.210 12.903 8.611 1.00 0.00 H new ATOM 0 HE2 LYS A 254 0.019 14.260 7.965 1.00 0.00 H new ATOM 0 HE3 LYS A 254 -0.004 14.655 9.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 254 1.200 16.313 8.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 254 2.255 15.522 9.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 254 2.278 15.139 7.821 1.00 0.00 H new ATOM 454 N ILE A 255 -0.741 9.410 6.077 1.00 0.00 N ATOM 455 CA ILE A 255 -0.741 9.348 4.621 1.00 0.00 C ATOM 456 C ILE A 255 -0.453 10.717 4.013 1.00 0.00 C ATOM 457 O ILE A 255 -1.185 11.678 4.249 1.00 0.00 O ATOM 458 CB ILE A 255 -2.086 8.830 4.079 1.00 0.00 C ATOM 459 CG1 ILE A 255 -2.397 7.449 4.660 1.00 0.00 C ATOM 460 CG2 ILE A 255 -2.060 8.778 2.559 1.00 0.00 C ATOM 461 CD1 ILE A 255 -3.861 7.076 4.580 1.00 0.00 C ATOM 0 H ILE A 255 -1.661 9.557 6.493 1.00 0.00 H new ATOM 0 HA ILE A 255 0.048 8.652 4.335 1.00 0.00 H new ATOM 0 HB ILE A 255 -2.874 9.518 4.386 1.00 0.00 H new ATOM 0 HG12 ILE A 255 -1.810 6.700 4.129 1.00 0.00 H new ATOM 0 HG13 ILE A 255 -2.080 7.422 5.703 1.00 0.00 H new ATOM 0 HG21 ILE A 255 -3.018 8.410 2.191 1.00 0.00 H new ATOM 0 HG22 ILE A 255 -1.879 9.778 2.164 1.00 0.00 H new ATOM 0 HG23 ILE A 255 -1.264 8.109 2.231 1.00 0.00 H new ATOM 0 HD11 ILE A 255 -4.008 6.085 5.010 1.00 0.00 H new ATOM 0 HD12 ILE A 255 -4.453 7.804 5.135 1.00 0.00 H new ATOM 0 HD13 ILE A 255 -4.178 7.070 3.537 1.00 0.00 H new ATOM 473 N ASP A 256 0.615 10.796 3.227 1.00 0.00 N ATOM 474 CA ASP A 256 0.998 12.047 2.582 1.00 0.00 C ATOM 475 C ASP A 256 0.146 12.302 1.343 1.00 0.00 C ATOM 476 O ASP A 256 -0.278 13.429 1.091 1.00 0.00 O ATOM 477 CB ASP A 256 2.479 12.016 2.200 1.00 0.00 C ATOM 478 CG ASP A 256 3.390 12.029 3.412 1.00 0.00 C ATOM 479 OD1 ASP A 256 2.992 11.478 4.459 1.00 0.00 O ATOM 480 OD2 ASP A 256 4.501 12.592 3.313 1.00 0.00 O ATOM 0 H ASP A 256 1.231 10.009 3.021 1.00 0.00 H new ATOM 0 HA ASP A 256 0.830 12.859 3.290 1.00 0.00 H new ATOM 0 HB2 ASP A 256 2.680 11.123 1.608 1.00 0.00 H new ATOM 0 HB3 ASP A 256 2.706 12.875 1.569 1.00 0.00 H new ATOM 485 N ASN A 257 -0.101 11.247 0.573 1.00 0.00 N ATOM 486 CA ASN A 257 -0.902 11.358 -0.641 1.00 0.00 C ATOM 487 C ASN A 257 -1.285 9.978 -1.167 1.00 0.00 C ATOM 488 O ASN A 257 -0.517 9.023 -1.050 1.00 0.00 O ATOM 489 CB ASN A 257 -0.134 12.130 -1.715 1.00 0.00 C ATOM 490 CG ASN A 257 -1.054 12.779 -2.730 1.00 0.00 C ATOM 491 OD1 ASN A 257 -2.072 13.372 -2.372 1.00 0.00 O ATOM 492 ND2 ASN A 257 -0.700 12.669 -4.005 1.00 0.00 N ATOM 0 H ASN A 257 0.242 10.306 0.768 1.00 0.00 H new ATOM 0 HA ASN A 257 -1.815 11.901 -0.396 1.00 0.00 H new ATOM 0 HB2 ASN A 257 0.477 12.897 -1.240 1.00 0.00 H new ATOM 0 HB3 ASN A 257 0.548 11.452 -2.228 1.00 0.00 H new ATOM 0 HD21 ASN A 257 -1.280 13.085 -4.733 1.00 0.00 H new ATOM 0 HD22 ASN A 257 0.152 12.168 -4.256 1.00 0.00 H new ATOM 499 N ILE A 258 -2.477 9.882 -1.748 1.00 0.00 N ATOM 500 CA ILE A 258 -2.961 8.620 -2.294 1.00 0.00 C ATOM 501 C ILE A 258 -3.434 8.790 -3.733 1.00 0.00 C ATOM 502 O ILE A 258 -4.246 9.665 -4.033 1.00 0.00 O ATOM 503 CB ILE A 258 -4.115 8.048 -1.450 1.00 0.00 C ATOM 504 CG1 ILE A 258 -3.638 7.754 -0.026 1.00 0.00 C ATOM 505 CG2 ILE A 258 -4.671 6.789 -2.098 1.00 0.00 C ATOM 506 CD1 ILE A 258 -4.760 7.413 0.929 1.00 0.00 C ATOM 0 H ILE A 258 -3.125 10.663 -1.852 1.00 0.00 H new ATOM 0 HA ILE A 258 -2.123 7.923 -2.269 1.00 0.00 H new ATOM 0 HB ILE A 258 -4.912 8.790 -1.400 1.00 0.00 H new ATOM 0 HG12 ILE A 258 -2.930 6.926 -0.052 1.00 0.00 H new ATOM 0 HG13 ILE A 258 -3.099 8.622 0.354 1.00 0.00 H new ATOM 0 HG21 ILE A 258 -5.486 6.396 -1.490 1.00 0.00 H new ATOM 0 HG22 ILE A 258 -5.044 7.027 -3.094 1.00 0.00 H new ATOM 0 HG23 ILE A 258 -3.882 6.041 -2.175 1.00 0.00 H new ATOM 0 HD11 ILE A 258 -4.348 7.217 1.919 1.00 0.00 H new ATOM 0 HD12 ILE A 258 -5.457 8.249 0.985 1.00 0.00 H new ATOM 0 HD13 ILE A 258 -5.285 6.527 0.572 1.00 0.00 H new ATOM 518 N VAL A 259 -2.921 7.944 -4.622 1.00 0.00 N ATOM 519 CA VAL A 259 -3.293 7.998 -6.031 1.00 0.00 C ATOM 520 C VAL A 259 -3.705 6.622 -6.543 1.00 0.00 C ATOM 521 O VAL A 259 -3.085 5.612 -6.209 1.00 0.00 O ATOM 522 CB VAL A 259 -2.136 8.531 -6.897 1.00 0.00 C ATOM 523 CG1 VAL A 259 -1.879 10.000 -6.599 1.00 0.00 C ATOM 524 CG2 VAL A 259 -0.879 7.704 -6.672 1.00 0.00 C ATOM 0 H VAL A 259 -2.247 7.214 -4.391 1.00 0.00 H new ATOM 0 HA VAL A 259 -4.139 8.680 -6.109 1.00 0.00 H new ATOM 0 HB VAL A 259 -2.419 8.443 -7.946 1.00 0.00 H new ATOM 0 HG11 VAL A 259 -1.058 10.359 -7.220 1.00 0.00 H new ATOM 0 HG12 VAL A 259 -2.778 10.578 -6.815 1.00 0.00 H new ATOM 0 HG13 VAL A 259 -1.617 10.117 -5.548 1.00 0.00 H new ATOM 0 HG21 VAL A 259 -0.071 8.094 -7.291 1.00 0.00 H new ATOM 0 HG22 VAL A 259 -0.590 7.759 -5.622 1.00 0.00 H new ATOM 0 HG23 VAL A 259 -1.074 6.666 -6.941 1.00 0.00 H new ATOM 534 N LEU A 260 -4.755 6.590 -7.356 1.00 0.00 N ATOM 535 CA LEU A 260 -5.251 5.338 -7.916 1.00 0.00 C ATOM 536 C LEU A 260 -5.006 5.279 -9.421 1.00 0.00 C ATOM 537 O LEU A 260 -5.177 6.273 -10.126 1.00 0.00 O ATOM 538 CB LEU A 260 -6.744 5.181 -7.624 1.00 0.00 C ATOM 539 CG LEU A 260 -7.106 4.686 -6.224 1.00 0.00 C ATOM 540 CD1 LEU A 260 -8.614 4.693 -6.028 1.00 0.00 C ATOM 541 CD2 LEU A 260 -6.542 3.292 -5.989 1.00 0.00 C ATOM 0 H LEU A 260 -5.279 7.417 -7.642 1.00 0.00 H new ATOM 0 HA LEU A 260 -4.707 4.518 -7.446 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -7.228 6.145 -7.783 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -7.165 4.488 -8.353 1.00 0.00 H new ATOM 0 HG LEU A 260 -6.663 5.364 -5.494 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -8.852 4.337 -5.026 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -8.992 5.708 -6.153 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -9.080 4.039 -6.765 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -6.809 2.955 -4.987 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -6.956 2.603 -6.726 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -5.457 3.318 -6.085 1.00 0.00 H new ATOM 553 N MET A 261 -4.608 4.108 -9.905 1.00 0.00 N ATOM 554 CA MET A 261 -4.344 3.920 -11.327 1.00 0.00 C ATOM 555 C MET A 261 -5.545 3.291 -12.025 1.00 0.00 C ATOM 556 O MET A 261 -5.972 2.189 -11.677 1.00 0.00 O ATOM 557 CB MET A 261 -3.107 3.042 -11.526 1.00 0.00 C ATOM 558 CG MET A 261 -1.909 3.484 -10.701 1.00 0.00 C ATOM 559 SD MET A 261 -1.219 5.052 -11.263 1.00 0.00 S ATOM 560 CE MET A 261 -1.744 6.145 -9.944 1.00 0.00 C ATOM 0 H MET A 261 -4.461 3.275 -9.335 1.00 0.00 H new ATOM 0 HA MET A 261 -4.161 4.899 -11.769 1.00 0.00 H new ATOM 0 HB2 MET A 261 -3.356 2.013 -11.267 1.00 0.00 H new ATOM 0 HB3 MET A 261 -2.833 3.048 -12.581 1.00 0.00 H new ATOM 0 HG2 MET A 261 -2.206 3.576 -9.656 1.00 0.00 H new ATOM 0 HG3 MET A 261 -1.138 2.715 -10.747 1.00 0.00 H new ATOM 0 HE1 MET A 261 -0.954 6.866 -9.733 1.00 0.00 H new ATOM 0 HE2 MET A 261 -2.647 6.674 -10.248 1.00 0.00 H new ATOM 0 HE3 MET A 261 -1.950 5.560 -9.047 1.00 0.00 H new ATOM 705 N GLY A 271 -6.835 -2.546 -10.445 1.00 0.00 N ATOM 706 CA GLY A 271 -6.888 -3.264 -9.185 1.00 0.00 C ATOM 707 C GLY A 271 -5.680 -2.992 -8.311 1.00 0.00 C ATOM 708 O GLY A 271 -5.273 -3.844 -7.520 1.00 0.00 O ATOM 0 HA2 GLY A 271 -7.793 -2.981 -8.647 1.00 0.00 H new ATOM 0 HA3 GLY A 271 -6.956 -4.334 -9.383 1.00 0.00 H new ATOM 712 N TYR A 272 -5.104 -1.804 -8.454 1.00 0.00 N ATOM 713 CA TYR A 272 -3.933 -1.423 -7.673 1.00 0.00 C ATOM 714 C TYR A 272 -3.888 0.087 -7.459 1.00 0.00 C ATOM 715 O TYR A 272 -4.592 0.842 -8.129 1.00 0.00 O ATOM 716 CB TYR A 272 -2.655 -1.889 -8.373 1.00 0.00 C ATOM 717 CG TYR A 272 -2.300 -1.069 -9.593 1.00 0.00 C ATOM 718 CD1 TYR A 272 -3.178 -0.967 -10.665 1.00 0.00 C ATOM 719 CD2 TYR A 272 -1.086 -0.398 -9.675 1.00 0.00 C ATOM 720 CE1 TYR A 272 -2.858 -0.220 -11.782 1.00 0.00 C ATOM 721 CE2 TYR A 272 -0.758 0.352 -10.788 1.00 0.00 C ATOM 722 CZ TYR A 272 -1.647 0.438 -11.839 1.00 0.00 C ATOM 723 OH TYR A 272 -1.324 1.183 -12.950 1.00 0.00 O ATOM 0 H TYR A 272 -5.429 -1.088 -9.104 1.00 0.00 H new ATOM 0 HA TYR A 272 -4.004 -1.907 -6.699 1.00 0.00 H new ATOM 0 HB2 TYR A 272 -1.827 -1.849 -7.665 1.00 0.00 H new ATOM 0 HB3 TYR A 272 -2.772 -2.932 -8.668 1.00 0.00 H new ATOM 0 HD1 TYR A 272 -4.127 -1.481 -10.624 1.00 0.00 H new ATOM 0 HD2 TYR A 272 -0.387 -0.464 -8.855 1.00 0.00 H new ATOM 0 HE1 TYR A 272 -3.552 -0.151 -12.606 1.00 0.00 H new ATOM 0 HE2 TYR A 272 0.189 0.868 -10.835 1.00 0.00 H new ATOM 0 HH TYR A 272 -0.437 1.582 -12.830 1.00 0.00 H new ATOM 733 N GLY A 273 -3.053 0.520 -6.520 1.00 0.00 N ATOM 734 CA GLY A 273 -2.929 1.938 -6.233 1.00 0.00 C ATOM 735 C GLY A 273 -1.614 2.281 -5.564 1.00 0.00 C ATOM 736 O GLY A 273 -0.883 1.394 -5.122 1.00 0.00 O ATOM 0 H GLY A 273 -2.460 -0.085 -5.952 1.00 0.00 H new ATOM 0 HA2 GLY A 273 -3.019 2.503 -7.161 1.00 0.00 H new ATOM 0 HA3 GLY A 273 -3.752 2.249 -5.590 1.00 0.00 H new ATOM 740 N PHE A 274 -1.309 3.573 -5.489 1.00 0.00 N ATOM 741 CA PHE A 274 -0.071 4.032 -4.871 1.00 0.00 C ATOM 742 C PHE A 274 -0.360 4.837 -3.608 1.00 0.00 C ATOM 743 O PHE A 274 -1.276 5.660 -3.579 1.00 0.00 O ATOM 744 CB PHE A 274 0.733 4.881 -5.858 1.00 0.00 C ATOM 745 CG PHE A 274 1.523 4.068 -6.843 1.00 0.00 C ATOM 746 CD1 PHE A 274 2.532 3.222 -6.412 1.00 0.00 C ATOM 747 CD2 PHE A 274 1.257 4.150 -8.200 1.00 0.00 C ATOM 748 CE1 PHE A 274 3.261 2.472 -7.316 1.00 0.00 C ATOM 749 CE2 PHE A 274 1.982 3.402 -9.109 1.00 0.00 C ATOM 750 CZ PHE A 274 2.987 2.563 -8.666 1.00 0.00 C ATOM 0 H PHE A 274 -1.903 4.320 -5.849 1.00 0.00 H new ATOM 0 HA PHE A 274 0.515 3.155 -4.596 1.00 0.00 H new ATOM 0 HB2 PHE A 274 0.051 5.534 -6.402 1.00 0.00 H new ATOM 0 HB3 PHE A 274 1.414 5.524 -5.301 1.00 0.00 H new ATOM 0 HD1 PHE A 274 2.752 3.148 -5.357 1.00 0.00 H new ATOM 0 HD2 PHE A 274 0.474 4.806 -8.552 1.00 0.00 H new ATOM 0 HE1 PHE A 274 4.044 1.816 -6.966 1.00 0.00 H new ATOM 0 HE2 PHE A 274 1.763 3.473 -10.164 1.00 0.00 H new ATOM 0 HZ PHE A 274 3.557 1.980 -9.374 1.00 0.00 H new ATOM 760 N ILE A 275 0.428 4.594 -2.565 1.00 0.00 N ATOM 761 CA ILE A 275 0.257 5.297 -1.300 1.00 0.00 C ATOM 762 C ILE A 275 1.603 5.716 -0.718 1.00 0.00 C ATOM 763 O ILE A 275 2.550 4.929 -0.684 1.00 0.00 O ATOM 764 CB ILE A 275 -0.486 4.427 -0.269 1.00 0.00 C ATOM 765 CG1 ILE A 275 -1.870 4.043 -0.797 1.00 0.00 C ATOM 766 CG2 ILE A 275 -0.605 5.163 1.058 1.00 0.00 C ATOM 767 CD1 ILE A 275 -2.578 3.014 0.057 1.00 0.00 C ATOM 0 H ILE A 275 1.190 3.916 -2.572 1.00 0.00 H new ATOM 0 HA ILE A 275 -0.338 6.186 -1.510 1.00 0.00 H new ATOM 0 HB ILE A 275 0.087 3.514 -0.106 1.00 0.00 H new ATOM 0 HG12 ILE A 275 -2.488 4.939 -0.859 1.00 0.00 H new ATOM 0 HG13 ILE A 275 -1.769 3.655 -1.810 1.00 0.00 H new ATOM 0 HG21 ILE A 275 -1.132 4.535 1.776 1.00 0.00 H new ATOM 0 HG22 ILE A 275 0.391 5.391 1.438 1.00 0.00 H new ATOM 0 HG23 ILE A 275 -1.159 6.090 0.911 1.00 0.00 H new ATOM 0 HD11 ILE A 275 -3.552 2.790 -0.377 1.00 0.00 H new ATOM 0 HD12 ILE A 275 -1.981 2.103 0.099 1.00 0.00 H new ATOM 0 HD13 ILE A 275 -2.711 3.407 1.065 1.00 0.00 H new ATOM 779 N THR A 276 1.681 6.961 -0.258 1.00 0.00 N ATOM 780 CA THR A 276 2.910 7.485 0.324 1.00 0.00 C ATOM 781 C THR A 276 2.708 7.868 1.785 1.00 0.00 C ATOM 782 O THR A 276 1.770 8.592 2.123 1.00 0.00 O ATOM 783 CB THR A 276 3.419 8.715 -0.452 1.00 0.00 C ATOM 784 OG1 THR A 276 3.660 8.367 -1.820 1.00 0.00 O ATOM 785 CG2 THR A 276 4.696 9.258 0.171 1.00 0.00 C ATOM 0 H THR A 276 0.907 7.625 -0.277 1.00 0.00 H new ATOM 0 HA THR A 276 3.653 6.690 0.260 1.00 0.00 H new ATOM 0 HB THR A 276 2.653 9.489 -0.404 1.00 0.00 H new ATOM 0 HG1 THR A 276 3.982 9.155 -2.306 1.00 0.00 H new ATOM 0 HG21 THR A 276 5.036 10.126 -0.394 1.00 0.00 H new ATOM 0 HG22 THR A 276 4.502 9.550 1.203 1.00 0.00 H new ATOM 0 HG23 THR A 276 5.467 8.487 0.151 1.00 0.00 H new ATOM 793 N PHE A 277 3.592 7.379 2.648 1.00 0.00 N ATOM 794 CA PHE A 277 3.509 7.671 4.075 1.00 0.00 C ATOM 795 C PHE A 277 4.475 8.788 4.458 1.00 0.00 C ATOM 796 O PHE A 277 5.221 9.294 3.620 1.00 0.00 O ATOM 797 CB PHE A 277 3.815 6.414 4.892 1.00 0.00 C ATOM 798 CG PHE A 277 2.654 5.466 4.990 1.00 0.00 C ATOM 799 CD1 PHE A 277 2.410 4.542 3.986 1.00 0.00 C ATOM 800 CD2 PHE A 277 1.807 5.498 6.086 1.00 0.00 C ATOM 801 CE1 PHE A 277 1.344 3.668 4.073 1.00 0.00 C ATOM 802 CE2 PHE A 277 0.739 4.626 6.178 1.00 0.00 C ATOM 803 CZ PHE A 277 0.506 3.711 5.171 1.00 0.00 C ATOM 0 H PHE A 277 4.374 6.779 2.385 1.00 0.00 H new ATOM 0 HA PHE A 277 2.494 8.001 4.295 1.00 0.00 H new ATOM 0 HB2 PHE A 277 4.661 5.895 4.442 1.00 0.00 H new ATOM 0 HB3 PHE A 277 4.119 6.708 5.896 1.00 0.00 H new ATOM 0 HD1 PHE A 277 3.061 4.505 3.125 1.00 0.00 H new ATOM 0 HD2 PHE A 277 1.983 6.212 6.877 1.00 0.00 H new ATOM 0 HE1 PHE A 277 1.166 2.952 3.284 1.00 0.00 H new ATOM 0 HE2 PHE A 277 0.086 4.660 7.038 1.00 0.00 H new ATOM 0 HZ PHE A 277 -0.329 3.030 5.241 1.00 0.00 H new ATOM 813 N SER A 278 4.455 9.168 5.732 1.00 0.00 N ATOM 814 CA SER A 278 5.325 10.229 6.227 1.00 0.00 C ATOM 815 C SER A 278 6.557 9.645 6.911 1.00 0.00 C ATOM 816 O SER A 278 7.654 10.195 6.813 1.00 0.00 O ATOM 817 CB SER A 278 4.564 11.128 7.203 1.00 0.00 C ATOM 818 OG SER A 278 4.316 10.458 8.427 1.00 0.00 O ATOM 0 H SER A 278 3.846 8.757 6.440 1.00 0.00 H new ATOM 0 HA SER A 278 5.652 10.825 5.375 1.00 0.00 H new ATOM 0 HB2 SER A 278 5.139 12.035 7.391 1.00 0.00 H new ATOM 0 HB3 SER A 278 3.619 11.437 6.756 1.00 0.00 H new ATOM 0 HG SER A 278 3.976 11.098 9.087 1.00 0.00 H new ATOM 824 N ASP A 279 6.367 8.528 7.604 1.00 0.00 N ATOM 825 CA ASP A 279 7.462 7.867 8.305 1.00 0.00 C ATOM 826 C ASP A 279 7.729 6.485 7.716 1.00 0.00 C ATOM 827 O ASP A 279 6.812 5.680 7.557 1.00 0.00 O ATOM 828 CB ASP A 279 7.144 7.747 9.796 1.00 0.00 C ATOM 829 CG ASP A 279 7.610 8.954 10.587 1.00 0.00 C ATOM 830 OD1 ASP A 279 8.836 9.103 10.774 1.00 0.00 O ATOM 831 OD2 ASP A 279 6.749 9.749 11.017 1.00 0.00 O ATOM 0 H ASP A 279 5.465 8.061 7.696 1.00 0.00 H new ATOM 0 HA ASP A 279 8.359 8.474 8.181 1.00 0.00 H new ATOM 0 HB2 ASP A 279 6.069 7.624 9.926 1.00 0.00 H new ATOM 0 HB3 ASP A 279 7.618 6.850 10.195 1.00 0.00 H new ATOM 836 N SER A 280 8.991 6.219 7.394 1.00 0.00 N ATOM 837 CA SER A 280 9.378 4.936 6.818 1.00 0.00 C ATOM 838 C SER A 280 8.982 3.786 7.739 1.00 0.00 C ATOM 839 O SER A 280 8.562 2.725 7.278 1.00 0.00 O ATOM 840 CB SER A 280 10.885 4.903 6.561 1.00 0.00 C ATOM 841 OG SER A 280 11.604 4.692 7.764 1.00 0.00 O ATOM 0 H SER A 280 9.762 6.874 7.522 1.00 0.00 H new ATOM 0 HA SER A 280 8.852 4.817 5.871 1.00 0.00 H new ATOM 0 HB2 SER A 280 11.118 4.110 5.851 1.00 0.00 H new ATOM 0 HB3 SER A 280 11.200 5.842 6.106 1.00 0.00 H new ATOM 0 HG SER A 280 12.565 4.673 7.572 1.00 0.00 H new ATOM 847 N GLU A 281 9.121 4.005 9.043 1.00 0.00 N ATOM 848 CA GLU A 281 8.779 2.987 10.029 1.00 0.00 C ATOM 849 C GLU A 281 7.294 2.640 9.961 1.00 0.00 C ATOM 850 O GLU A 281 6.916 1.470 10.017 1.00 0.00 O ATOM 851 CB GLU A 281 9.138 3.467 11.437 1.00 0.00 C ATOM 852 CG GLU A 281 8.508 4.800 11.804 1.00 0.00 C ATOM 853 CD GLU A 281 8.716 5.161 13.262 1.00 0.00 C ATOM 854 OE1 GLU A 281 8.653 4.250 14.113 1.00 0.00 O ATOM 855 OE2 GLU A 281 8.941 6.355 13.552 1.00 0.00 O ATOM 0 H GLU A 281 9.468 4.878 9.441 1.00 0.00 H new ATOM 0 HA GLU A 281 9.355 2.090 9.801 1.00 0.00 H new ATOM 0 HB2 GLU A 281 8.823 2.714 12.160 1.00 0.00 H new ATOM 0 HB3 GLU A 281 10.222 3.552 11.518 1.00 0.00 H new ATOM 0 HG2 GLU A 281 8.932 5.583 11.175 1.00 0.00 H new ATOM 0 HG3 GLU A 281 7.440 4.764 11.591 1.00 0.00 H new ATOM 862 N CYS A 282 6.459 3.666 9.841 1.00 0.00 N ATOM 863 CA CYS A 282 5.015 3.471 9.767 1.00 0.00 C ATOM 864 C CYS A 282 4.639 2.657 8.533 1.00 0.00 C ATOM 865 O CYS A 282 3.729 1.831 8.576 1.00 0.00 O ATOM 866 CB CYS A 282 4.298 4.822 9.740 1.00 0.00 C ATOM 867 SG CYS A 282 4.321 5.701 11.320 1.00 0.00 S ATOM 0 H CYS A 282 6.756 4.641 9.793 1.00 0.00 H new ATOM 0 HA CYS A 282 4.701 2.919 10.653 1.00 0.00 H new ATOM 0 HB2 CYS A 282 4.760 5.451 8.979 1.00 0.00 H new ATOM 0 HB3 CYS A 282 3.262 4.666 9.438 1.00 0.00 H new ATOM 0 HG CYS A 282 3.692 6.832 11.196 1.00 0.00 H new ATOM 873 N ALA A 283 5.345 2.899 7.433 1.00 0.00 N ATOM 874 CA ALA A 283 5.085 2.189 6.187 1.00 0.00 C ATOM 875 C ALA A 283 5.416 0.706 6.321 1.00 0.00 C ATOM 876 O ALA A 283 4.691 -0.149 5.813 1.00 0.00 O ATOM 877 CB ALA A 283 5.884 2.808 5.050 1.00 0.00 C ATOM 0 H ALA A 283 6.101 3.581 7.380 1.00 0.00 H new ATOM 0 HA ALA A 283 4.022 2.279 5.962 1.00 0.00 H new ATOM 0 HB1 ALA A 283 5.680 2.268 4.126 1.00 0.00 H new ATOM 0 HB2 ALA A 283 5.597 3.853 4.930 1.00 0.00 H new ATOM 0 HB3 ALA A 283 6.948 2.748 5.278 1.00 0.00 H new ATOM 883 N ARG A 284 6.514 0.409 7.008 1.00 0.00 N ATOM 884 CA ARG A 284 6.941 -0.971 7.207 1.00 0.00 C ATOM 885 C ARG A 284 5.894 -1.756 7.992 1.00 0.00 C ATOM 886 O ARG A 284 5.505 -2.856 7.599 1.00 0.00 O ATOM 887 CB ARG A 284 8.281 -1.011 7.944 1.00 0.00 C ATOM 888 CG ARG A 284 8.865 -2.409 8.069 1.00 0.00 C ATOM 889 CD ARG A 284 10.317 -2.367 8.521 1.00 0.00 C ATOM 890 NE ARG A 284 10.812 -3.690 8.893 1.00 0.00 N ATOM 891 CZ ARG A 284 11.159 -4.619 8.010 1.00 0.00 C ATOM 892 NH1 ARG A 284 11.066 -4.372 6.711 1.00 0.00 N ATOM 893 NH2 ARG A 284 11.601 -5.799 8.426 1.00 0.00 N ATOM 0 H ARG A 284 7.124 1.105 7.436 1.00 0.00 H new ATOM 0 HA ARG A 284 7.058 -1.434 6.227 1.00 0.00 H new ATOM 0 HB2 ARG A 284 8.994 -0.374 7.420 1.00 0.00 H new ATOM 0 HB3 ARG A 284 8.151 -0.590 8.941 1.00 0.00 H new ATOM 0 HG2 ARG A 284 8.277 -2.988 8.782 1.00 0.00 H new ATOM 0 HG3 ARG A 284 8.796 -2.921 7.109 1.00 0.00 H new ATOM 0 HD2 ARG A 284 10.935 -1.961 7.720 1.00 0.00 H new ATOM 0 HD3 ARG A 284 10.413 -1.692 9.371 1.00 0.00 H new ATOM 0 HE ARG A 284 10.896 -3.912 9.885 1.00 0.00 H new ATOM 0 HH11 ARG A 284 10.727 -3.466 6.387 1.00 0.00 H new ATOM 0 HH12 ARG A 284 11.333 -5.088 6.035 1.00 0.00 H new ATOM 0 HH21 ARG A 284 11.674 -5.993 9.425 1.00 0.00 H new ATOM 0 HH22 ARG A 284 11.867 -6.512 7.747 1.00 0.00 H new ATOM 907 N ARG A 285 5.442 -1.183 9.103 1.00 0.00 N ATOM 908 CA ARG A 285 4.441 -1.830 9.943 1.00 0.00 C ATOM 909 C ARG A 285 3.166 -2.109 9.154 1.00 0.00 C ATOM 910 O ARG A 285 2.656 -3.229 9.153 1.00 0.00 O ATOM 911 CB ARG A 285 4.122 -0.956 11.157 1.00 0.00 C ATOM 912 CG ARG A 285 5.094 -1.136 12.311 1.00 0.00 C ATOM 913 CD ARG A 285 4.930 -2.497 12.971 1.00 0.00 C ATOM 914 NE ARG A 285 5.849 -2.676 14.092 1.00 0.00 N ATOM 915 CZ ARG A 285 6.113 -3.855 14.644 1.00 0.00 C ATOM 916 NH1 ARG A 285 5.532 -4.953 14.181 1.00 0.00 N ATOM 917 NH2 ARG A 285 6.961 -3.938 15.661 1.00 0.00 N ATOM 0 H ARG A 285 5.753 -0.273 9.442 1.00 0.00 H new ATOM 0 HA ARG A 285 4.850 -2.781 10.285 1.00 0.00 H new ATOM 0 HB2 ARG A 285 4.124 0.090 10.851 1.00 0.00 H new ATOM 0 HB3 ARG A 285 3.114 -1.184 11.503 1.00 0.00 H new ATOM 0 HG2 ARG A 285 6.116 -1.027 11.948 1.00 0.00 H new ATOM 0 HG3 ARG A 285 4.933 -0.351 13.049 1.00 0.00 H new ATOM 0 HD2 ARG A 285 3.904 -2.608 13.322 1.00 0.00 H new ATOM 0 HD3 ARG A 285 5.101 -3.281 12.233 1.00 0.00 H new ATOM 0 HE ARG A 285 6.313 -1.851 14.472 1.00 0.00 H new ATOM 0 HH11 ARG A 285 4.880 -4.894 13.399 1.00 0.00 H new ATOM 0 HH12 ARG A 285 5.737 -5.857 14.607 1.00 0.00 H new ATOM 0 HH21 ARG A 285 7.411 -3.096 16.020 1.00 0.00 H new ATOM 0 HH22 ARG A 285 7.163 -4.844 16.084 1.00 0.00 H new ATOM 931 N ALA A 286 2.655 -1.081 8.483 1.00 0.00 N ATOM 932 CA ALA A 286 1.440 -1.216 7.688 1.00 0.00 C ATOM 933 C ALA A 286 1.596 -2.300 6.627 1.00 0.00 C ATOM 934 O ALA A 286 0.642 -3.011 6.307 1.00 0.00 O ATOM 935 CB ALA A 286 1.085 0.113 7.039 1.00 0.00 C ATOM 0 H ALA A 286 3.063 -0.146 8.474 1.00 0.00 H new ATOM 0 HA ALA A 286 0.629 -1.511 8.354 1.00 0.00 H new ATOM 0 HB1 ALA A 286 0.176 -0.002 6.448 1.00 0.00 H new ATOM 0 HB2 ALA A 286 0.923 0.864 7.812 1.00 0.00 H new ATOM 0 HB3 ALA A 286 1.901 0.431 6.390 1.00 0.00 H new ATOM 941 N LEU A 287 2.802 -2.422 6.085 1.00 0.00 N ATOM 942 CA LEU A 287 3.082 -3.420 5.058 1.00 0.00 C ATOM 943 C LEU A 287 2.942 -4.832 5.619 1.00 0.00 C ATOM 944 O LEU A 287 2.389 -5.716 4.967 1.00 0.00 O ATOM 945 CB LEU A 287 4.490 -3.220 4.495 1.00 0.00 C ATOM 946 CG LEU A 287 5.049 -4.373 3.660 1.00 0.00 C ATOM 947 CD1 LEU A 287 4.489 -4.329 2.247 1.00 0.00 C ATOM 948 CD2 LEU A 287 6.570 -4.324 3.635 1.00 0.00 C ATOM 0 H LEU A 287 3.602 -1.843 6.339 1.00 0.00 H new ATOM 0 HA LEU A 287 2.355 -3.294 4.255 1.00 0.00 H new ATOM 0 HB2 LEU A 287 4.489 -2.320 3.880 1.00 0.00 H new ATOM 0 HB3 LEU A 287 5.170 -3.037 5.327 1.00 0.00 H new ATOM 0 HG LEU A 287 4.743 -5.312 4.121 1.00 0.00 H new ATOM 0 HD11 LEU A 287 4.898 -5.157 1.668 1.00 0.00 H new ATOM 0 HD12 LEU A 287 3.403 -4.413 2.283 1.00 0.00 H new ATOM 0 HD13 LEU A 287 4.764 -3.385 1.776 1.00 0.00 H new ATOM 0 HD21 LEU A 287 6.951 -5.152 3.037 1.00 0.00 H new ATOM 0 HD22 LEU A 287 6.896 -3.380 3.199 1.00 0.00 H new ATOM 0 HD23 LEU A 287 6.953 -4.405 4.652 1.00 0.00 H new ATOM 960 N GLU A 288 3.446 -5.033 6.833 1.00 0.00 N ATOM 961 CA GLU A 288 3.375 -6.337 7.481 1.00 0.00 C ATOM 962 C GLU A 288 1.937 -6.682 7.856 1.00 0.00 C ATOM 963 O GLU A 288 1.489 -7.812 7.664 1.00 0.00 O ATOM 964 CB GLU A 288 4.258 -6.359 8.731 1.00 0.00 C ATOM 965 CG GLU A 288 5.668 -5.847 8.489 1.00 0.00 C ATOM 966 CD GLU A 288 6.688 -6.490 9.408 1.00 0.00 C ATOM 967 OE1 GLU A 288 6.333 -6.799 10.565 1.00 0.00 O ATOM 968 OE2 GLU A 288 7.841 -6.685 8.970 1.00 0.00 O ATOM 0 H GLU A 288 3.907 -4.311 7.386 1.00 0.00 H new ATOM 0 HA GLU A 288 3.737 -7.084 6.775 1.00 0.00 H new ATOM 0 HB2 GLU A 288 3.789 -5.754 9.507 1.00 0.00 H new ATOM 0 HB3 GLU A 288 4.311 -7.380 9.110 1.00 0.00 H new ATOM 0 HG2 GLU A 288 5.947 -6.038 7.453 1.00 0.00 H new ATOM 0 HG3 GLU A 288 5.687 -4.766 8.630 1.00 0.00 H new ATOM 975 N GLN A 289 1.219 -5.699 8.390 1.00 0.00 N ATOM 976 CA GLN A 289 -0.168 -5.899 8.793 1.00 0.00 C ATOM 977 C GLN A 289 -1.076 -6.023 7.574 1.00 0.00 C ATOM 978 O GLN A 289 -2.041 -6.789 7.580 1.00 0.00 O ATOM 979 CB GLN A 289 -0.637 -4.741 9.676 1.00 0.00 C ATOM 980 CG GLN A 289 -0.171 -4.850 11.119 1.00 0.00 C ATOM 981 CD GLN A 289 -0.481 -6.202 11.732 1.00 0.00 C ATOM 982 OE1 GLN A 289 0.313 -7.138 11.635 1.00 0.00 O ATOM 983 NE2 GLN A 289 -1.642 -6.311 12.368 1.00 0.00 N ATOM 0 H GLN A 289 1.574 -4.757 8.553 1.00 0.00 H new ATOM 0 HA GLN A 289 -0.224 -6.827 9.362 1.00 0.00 H new ATOM 0 HB2 GLN A 289 -0.273 -3.804 9.255 1.00 0.00 H new ATOM 0 HB3 GLN A 289 -1.726 -4.698 9.657 1.00 0.00 H new ATOM 0 HG2 GLN A 289 0.904 -4.673 11.164 1.00 0.00 H new ATOM 0 HG3 GLN A 289 -0.648 -4.069 11.711 1.00 0.00 H new ATOM 0 HE21 GLN A 289 -2.270 -5.509 12.424 1.00 0.00 H new ATOM 0 HE22 GLN A 289 -1.906 -7.196 12.800 1.00 0.00 H new ATOM 992 N LEU A 290 -0.762 -5.265 6.529 1.00 0.00 N ATOM 993 CA LEU A 290 -1.550 -5.289 5.301 1.00 0.00 C ATOM 994 C LEU A 290 -1.266 -6.554 4.497 1.00 0.00 C ATOM 995 O LEU A 290 -2.186 -7.227 4.034 1.00 0.00 O ATOM 996 CB LEU A 290 -1.248 -4.053 4.453 1.00 0.00 C ATOM 997 CG LEU A 290 -1.756 -2.720 5.004 1.00 0.00 C ATOM 998 CD1 LEU A 290 -1.064 -1.557 4.310 1.00 0.00 C ATOM 999 CD2 LEU A 290 -3.265 -2.617 4.844 1.00 0.00 C ATOM 0 H LEU A 290 0.033 -4.626 6.507 1.00 0.00 H new ATOM 0 HA LEU A 290 -2.605 -5.284 5.575 1.00 0.00 H new ATOM 0 HB2 LEU A 290 -0.168 -3.981 4.323 1.00 0.00 H new ATOM 0 HB3 LEU A 290 -1.679 -4.202 3.463 1.00 0.00 H new ATOM 0 HG LEU A 290 -1.520 -2.675 6.067 1.00 0.00 H new ATOM 0 HD11 LEU A 290 -1.438 -0.617 4.715 1.00 0.00 H new ATOM 0 HD12 LEU A 290 0.011 -1.622 4.477 1.00 0.00 H new ATOM 0 HD13 LEU A 290 -1.268 -1.598 3.240 1.00 0.00 H new ATOM 0 HD21 LEU A 290 -3.609 -1.662 5.242 1.00 0.00 H new ATOM 0 HD22 LEU A 290 -3.524 -2.685 3.787 1.00 0.00 H new ATOM 0 HD23 LEU A 290 -3.745 -3.430 5.388 1.00 0.00 H new ATOM 1011 N ASN A 291 0.014 -6.872 4.337 1.00 0.00 N ATOM 1012 CA ASN A 291 0.420 -8.057 3.591 1.00 0.00 C ATOM 1013 C ASN A 291 -0.473 -9.247 3.931 1.00 0.00 C ATOM 1014 O ASN A 291 -0.447 -9.756 5.050 1.00 0.00 O ATOM 1015 CB ASN A 291 1.880 -8.400 3.891 1.00 0.00 C ATOM 1016 CG ASN A 291 2.225 -9.832 3.530 1.00 0.00 C ATOM 1017 OD1 ASN A 291 2.285 -10.705 4.395 1.00 0.00 O ATOM 1018 ND2 ASN A 291 2.453 -10.079 2.245 1.00 0.00 N ATOM 0 H ASN A 291 0.788 -6.325 4.714 1.00 0.00 H new ATOM 0 HA ASN A 291 0.316 -7.839 2.528 1.00 0.00 H new ATOM 0 HB2 ASN A 291 2.530 -7.722 3.338 1.00 0.00 H new ATOM 0 HB3 ASN A 291 2.078 -8.238 4.951 1.00 0.00 H new ATOM 0 HD21 ASN A 291 2.689 -11.024 1.941 1.00 0.00 H new ATOM 0 HD22 ASN A 291 2.392 -9.324 1.562 1.00 0.00 H new ATOM 1025 N GLY A 292 -1.264 -9.684 2.955 1.00 0.00 N ATOM 1026 CA GLY A 292 -2.154 -10.810 3.170 1.00 0.00 C ATOM 1027 C GLY A 292 -3.350 -10.448 4.027 1.00 0.00 C ATOM 1028 O GLY A 292 -3.768 -11.227 4.884 1.00 0.00 O ATOM 0 H GLY A 292 -1.304 -9.278 2.020 1.00 0.00 H new ATOM 0 HA2 GLY A 292 -2.501 -11.184 2.207 1.00 0.00 H new ATOM 0 HA3 GLY A 292 -1.602 -11.620 3.646 1.00 0.00 H new ATOM 1032 N PHE A 293 -3.903 -9.262 3.797 1.00 0.00 N ATOM 1033 CA PHE A 293 -5.058 -8.796 4.557 1.00 0.00 C ATOM 1034 C PHE A 293 -6.344 -8.974 3.755 1.00 0.00 C ATOM 1035 O PHE A 293 -6.677 -8.148 2.906 1.00 0.00 O ATOM 1036 CB PHE A 293 -4.883 -7.326 4.941 1.00 0.00 C ATOM 1037 CG PHE A 293 -6.088 -6.735 5.616 1.00 0.00 C ATOM 1038 CD1 PHE A 293 -6.672 -7.369 6.700 1.00 0.00 C ATOM 1039 CD2 PHE A 293 -6.636 -5.545 5.165 1.00 0.00 C ATOM 1040 CE1 PHE A 293 -7.781 -6.828 7.322 1.00 0.00 C ATOM 1041 CE2 PHE A 293 -7.745 -4.999 5.783 1.00 0.00 C ATOM 1042 CZ PHE A 293 -8.318 -5.641 6.864 1.00 0.00 C ATOM 0 H PHE A 293 -3.570 -8.606 3.091 1.00 0.00 H new ATOM 0 HA PHE A 293 -5.130 -9.395 5.465 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -4.023 -7.232 5.604 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -4.659 -6.749 4.044 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -6.256 -8.297 7.063 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -6.192 -5.038 4.321 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -8.227 -7.333 8.166 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -8.163 -4.071 5.421 1.00 0.00 H new ATOM 0 HZ PHE A 293 -9.184 -5.216 7.350 1.00 0.00 H new ATOM 1052 N GLU A 294 -7.061 -10.059 4.031 1.00 0.00 N ATOM 1053 CA GLU A 294 -8.309 -10.346 3.334 1.00 0.00 C ATOM 1054 C GLU A 294 -9.298 -9.194 3.492 1.00 0.00 C ATOM 1055 O GLU A 294 -9.884 -9.006 4.558 1.00 0.00 O ATOM 1056 CB GLU A 294 -8.929 -11.640 3.865 1.00 0.00 C ATOM 1057 CG GLU A 294 -8.130 -12.885 3.517 1.00 0.00 C ATOM 1058 CD GLU A 294 -7.024 -13.166 4.515 1.00 0.00 C ATOM 1059 OE1 GLU A 294 -7.315 -13.773 5.567 1.00 0.00 O ATOM 1060 OE2 GLU A 294 -5.868 -12.780 4.244 1.00 0.00 O ATOM 0 H GLU A 294 -6.799 -10.753 4.731 1.00 0.00 H new ATOM 0 HA GLU A 294 -8.084 -10.467 2.274 1.00 0.00 H new ATOM 0 HB2 GLU A 294 -9.023 -11.570 4.949 1.00 0.00 H new ATOM 0 HB3 GLU A 294 -9.937 -11.741 3.463 1.00 0.00 H new ATOM 0 HG2 GLU A 294 -8.801 -13.743 3.473 1.00 0.00 H new ATOM 0 HG3 GLU A 294 -7.697 -12.768 2.524 1.00 0.00 H new ATOM 1067 N LEU A 295 -9.476 -8.426 2.423 1.00 0.00 N ATOM 1068 CA LEU A 295 -10.393 -7.291 2.441 1.00 0.00 C ATOM 1069 C LEU A 295 -11.763 -7.689 1.902 1.00 0.00 C ATOM 1070 O LEU A 295 -12.783 -7.484 2.558 1.00 0.00 O ATOM 1071 CB LEU A 295 -9.823 -6.136 1.615 1.00 0.00 C ATOM 1072 CG LEU A 295 -10.414 -4.754 1.896 1.00 0.00 C ATOM 1073 CD1 LEU A 295 -9.507 -3.664 1.347 1.00 0.00 C ATOM 1074 CD2 LEU A 295 -11.810 -4.640 1.299 1.00 0.00 C ATOM 0 H LEU A 295 -8.998 -8.568 1.533 1.00 0.00 H new ATOM 0 HA LEU A 295 -10.510 -6.967 3.475 1.00 0.00 H new ATOM 0 HB2 LEU A 295 -8.747 -6.090 1.785 1.00 0.00 H new ATOM 0 HB3 LEU A 295 -9.969 -6.364 0.559 1.00 0.00 H new ATOM 0 HG LEU A 295 -10.490 -4.625 2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 295 -9.944 -2.688 1.556 1.00 0.00 H new ATOM 0 HD12 LEU A 295 -8.528 -3.733 1.821 1.00 0.00 H new ATOM 0 HD13 LEU A 295 -9.398 -3.789 0.270 1.00 0.00 H new ATOM 0 HD21 LEU A 295 -12.216 -3.650 1.508 1.00 0.00 H new ATOM 0 HD22 LEU A 295 -11.758 -4.790 0.221 1.00 0.00 H new ATOM 0 HD23 LEU A 295 -12.457 -5.398 1.740 1.00 0.00 H new ATOM 1086 N ALA A 296 -11.778 -8.261 0.702 1.00 0.00 N ATOM 1087 CA ALA A 296 -13.022 -8.692 0.076 1.00 0.00 C ATOM 1088 C ALA A 296 -13.088 -10.213 -0.023 1.00 0.00 C ATOM 1089 O ALA A 296 -13.534 -10.760 -1.030 1.00 0.00 O ATOM 1090 CB ALA A 296 -13.164 -8.065 -1.302 1.00 0.00 C ATOM 0 H ALA A 296 -10.942 -8.437 0.144 1.00 0.00 H new ATOM 0 HA ALA A 296 -13.850 -8.358 0.702 1.00 0.00 H new ATOM 0 HB1 ALA A 296 -14.097 -8.396 -1.758 1.00 0.00 H new ATOM 0 HB2 ALA A 296 -13.170 -6.979 -1.209 1.00 0.00 H new ATOM 0 HB3 ALA A 296 -12.326 -8.370 -1.929 1.00 0.00 H new ATOM 1096 N GLY A 297 -12.641 -10.890 1.031 1.00 0.00 N ATOM 1097 CA GLY A 297 -12.658 -12.341 1.041 1.00 0.00 C ATOM 1098 C GLY A 297 -11.314 -12.939 0.677 1.00 0.00 C ATOM 1099 O GLY A 297 -10.927 -13.981 1.208 1.00 0.00 O ATOM 0 H GLY A 297 -12.268 -10.460 1.877 1.00 0.00 H new ATOM 0 HA2 GLY A 297 -12.952 -12.691 2.031 1.00 0.00 H new ATOM 0 HA3 GLY A 297 -13.413 -12.697 0.340 1.00 0.00 H new ATOM 1103 N ARG A 298 -10.601 -12.281 -0.231 1.00 0.00 N ATOM 1104 CA ARG A 298 -9.294 -12.756 -0.667 1.00 0.00 C ATOM 1105 C ARG A 298 -8.185 -11.837 -0.162 1.00 0.00 C ATOM 1106 O ARG A 298 -8.373 -10.631 0.006 1.00 0.00 O ATOM 1107 CB ARG A 298 -9.243 -12.844 -2.193 1.00 0.00 C ATOM 1108 CG ARG A 298 -10.247 -13.821 -2.781 1.00 0.00 C ATOM 1109 CD ARG A 298 -9.770 -15.259 -2.645 1.00 0.00 C ATOM 1110 NE ARG A 298 -10.867 -16.214 -2.778 1.00 0.00 N ATOM 1111 CZ ARG A 298 -10.688 -17.522 -2.931 1.00 0.00 C ATOM 1112 NH1 ARG A 298 -9.463 -18.026 -2.970 1.00 0.00 N ATOM 1113 NH2 ARG A 298 -11.737 -18.327 -3.045 1.00 0.00 N ATOM 0 H ARG A 298 -10.907 -11.417 -0.679 1.00 0.00 H new ATOM 0 HA ARG A 298 -9.138 -13.750 -0.247 1.00 0.00 H new ATOM 0 HB2 ARG A 298 -9.424 -11.854 -2.612 1.00 0.00 H new ATOM 0 HB3 ARG A 298 -8.239 -13.140 -2.498 1.00 0.00 H new ATOM 0 HG2 ARG A 298 -11.207 -13.706 -2.277 1.00 0.00 H new ATOM 0 HG3 ARG A 298 -10.409 -13.588 -3.833 1.00 0.00 H new ATOM 0 HD2 ARG A 298 -9.016 -15.464 -3.405 1.00 0.00 H new ATOM 0 HD3 ARG A 298 -9.289 -15.391 -1.676 1.00 0.00 H new ATOM 0 HE ARG A 298 -11.822 -15.858 -2.752 1.00 0.00 H new ATOM 0 HH11 ARG A 298 -8.655 -17.410 -2.882 1.00 0.00 H new ATOM 0 HH12 ARG A 298 -9.328 -19.030 -3.087 1.00 0.00 H new ATOM 0 HH21 ARG A 298 -12.681 -17.942 -3.015 1.00 0.00 H new ATOM 0 HH22 ARG A 298 -11.599 -19.331 -3.162 1.00 0.00 H new ATOM 1127 N PRO A 299 -7.002 -12.417 0.087 1.00 0.00 N ATOM 1128 CA PRO A 299 -5.840 -11.669 0.576 1.00 0.00 C ATOM 1129 C PRO A 299 -5.268 -10.730 -0.482 1.00 0.00 C ATOM 1130 O PRO A 299 -4.836 -11.170 -1.546 1.00 0.00 O ATOM 1131 CB PRO A 299 -4.830 -12.767 0.919 1.00 0.00 C ATOM 1132 CG PRO A 299 -5.212 -13.917 0.052 1.00 0.00 C ATOM 1133 CD PRO A 299 -6.707 -13.849 -0.091 1.00 0.00 C ATOM 0 HA PRO A 299 -6.094 -11.026 1.419 1.00 0.00 H new ATOM 0 HB2 PRO A 299 -3.809 -12.442 0.719 1.00 0.00 H new ATOM 0 HB3 PRO A 299 -4.878 -13.034 1.975 1.00 0.00 H new ATOM 0 HG2 PRO A 299 -4.724 -13.852 -0.920 1.00 0.00 H new ATOM 0 HG3 PRO A 299 -4.905 -14.862 0.500 1.00 0.00 H new ATOM 0 HD2 PRO A 299 -7.034 -14.208 -1.067 1.00 0.00 H new ATOM 0 HD3 PRO A 299 -7.211 -14.459 0.659 1.00 0.00 H new ATOM 1141 N MET A 300 -5.269 -9.436 -0.180 1.00 0.00 N ATOM 1142 CA MET A 300 -4.748 -8.436 -1.104 1.00 0.00 C ATOM 1143 C MET A 300 -3.228 -8.524 -1.201 1.00 0.00 C ATOM 1144 O MET A 300 -2.590 -9.251 -0.439 1.00 0.00 O ATOM 1145 CB MET A 300 -5.162 -7.033 -0.657 1.00 0.00 C ATOM 1146 CG MET A 300 -4.697 -6.680 0.746 1.00 0.00 C ATOM 1147 SD MET A 300 -5.806 -5.526 1.576 1.00 0.00 S ATOM 1148 CE MET A 300 -4.788 -4.054 1.627 1.00 0.00 C ATOM 0 H MET A 300 -5.625 -9.056 0.697 1.00 0.00 H new ATOM 0 HA MET A 300 -5.169 -8.634 -2.090 1.00 0.00 H new ATOM 0 HB2 MET A 300 -4.759 -6.303 -1.359 1.00 0.00 H new ATOM 0 HB3 MET A 300 -6.248 -6.952 -0.702 1.00 0.00 H new ATOM 0 HG2 MET A 300 -4.618 -7.592 1.338 1.00 0.00 H new ATOM 0 HG3 MET A 300 -3.699 -6.245 0.695 1.00 0.00 H new ATOM 0 HE1 MET A 300 -5.302 -3.276 2.191 1.00 0.00 H new ATOM 0 HE2 MET A 300 -3.838 -4.285 2.110 1.00 0.00 H new ATOM 0 HE3 MET A 300 -4.603 -3.704 0.611 1.00 0.00 H new ATOM 1158 N ARG A 301 -2.655 -7.780 -2.142 1.00 0.00 N ATOM 1159 CA ARG A 301 -1.211 -7.776 -2.338 1.00 0.00 C ATOM 1160 C ARG A 301 -0.597 -6.473 -1.836 1.00 0.00 C ATOM 1161 O ARG A 301 -1.004 -5.385 -2.244 1.00 0.00 O ATOM 1162 CB ARG A 301 -0.875 -7.973 -3.818 1.00 0.00 C ATOM 1163 CG ARG A 301 -0.811 -9.432 -4.239 1.00 0.00 C ATOM 1164 CD ARG A 301 0.571 -10.021 -4.000 1.00 0.00 C ATOM 1165 NE ARG A 301 0.716 -11.341 -4.607 1.00 0.00 N ATOM 1166 CZ ARG A 301 1.876 -11.980 -4.707 1.00 0.00 C ATOM 1167 NH1 ARG A 301 2.986 -11.424 -4.241 1.00 0.00 N ATOM 1168 NH2 ARG A 301 1.928 -13.179 -5.273 1.00 0.00 N ATOM 0 H ARG A 301 -3.169 -7.173 -2.780 1.00 0.00 H new ATOM 0 HA ARG A 301 -0.790 -8.601 -1.763 1.00 0.00 H new ATOM 0 HB2 ARG A 301 -1.624 -7.462 -4.423 1.00 0.00 H new ATOM 0 HB3 ARG A 301 0.084 -7.500 -4.030 1.00 0.00 H new ATOM 0 HG2 ARG A 301 -1.553 -10.005 -3.683 1.00 0.00 H new ATOM 0 HG3 ARG A 301 -1.067 -9.519 -5.295 1.00 0.00 H new ATOM 0 HD2 ARG A 301 1.327 -9.350 -4.408 1.00 0.00 H new ATOM 0 HD3 ARG A 301 0.754 -10.093 -2.928 1.00 0.00 H new ATOM 0 HE ARG A 301 -0.119 -11.797 -4.974 1.00 0.00 H new ATOM 0 HH11 ARG A 301 2.951 -10.503 -3.804 1.00 0.00 H new ATOM 0 HH12 ARG A 301 3.875 -11.917 -4.319 1.00 0.00 H new ATOM 0 HH21 ARG A 301 1.076 -13.611 -5.632 1.00 0.00 H new ATOM 0 HH22 ARG A 301 2.819 -13.669 -5.349 1.00 0.00 H new ATOM 1182 N VAL A 302 0.383 -6.591 -0.946 1.00 0.00 N ATOM 1183 CA VAL A 302 1.053 -5.422 -0.387 1.00 0.00 C ATOM 1184 C VAL A 302 2.568 -5.544 -0.515 1.00 0.00 C ATOM 1185 O VAL A 302 3.170 -6.490 -0.009 1.00 0.00 O ATOM 1186 CB VAL A 302 0.689 -5.222 1.095 1.00 0.00 C ATOM 1187 CG1 VAL A 302 1.118 -3.841 1.569 1.00 0.00 C ATOM 1188 CG2 VAL A 302 -0.803 -5.428 1.310 1.00 0.00 C ATOM 0 H VAL A 302 0.731 -7.484 -0.596 1.00 0.00 H new ATOM 0 HA VAL A 302 0.711 -4.558 -0.957 1.00 0.00 H new ATOM 0 HB VAL A 302 1.224 -5.965 1.686 1.00 0.00 H new ATOM 0 HG11 VAL A 302 0.852 -3.718 2.619 1.00 0.00 H new ATOM 0 HG12 VAL A 302 2.197 -3.735 1.453 1.00 0.00 H new ATOM 0 HG13 VAL A 302 0.613 -3.079 0.975 1.00 0.00 H new ATOM 0 HG21 VAL A 302 -1.042 -5.283 2.363 1.00 0.00 H new ATOM 0 HG22 VAL A 302 -1.360 -4.709 0.709 1.00 0.00 H new ATOM 0 HG23 VAL A 302 -1.077 -6.440 1.012 1.00 0.00 H new ATOM 1198 N GLY A 303 3.178 -4.579 -1.196 1.00 0.00 N ATOM 1199 CA GLY A 303 4.618 -4.596 -1.378 1.00 0.00 C ATOM 1200 C GLY A 303 5.215 -3.203 -1.412 1.00 0.00 C ATOM 1201 O GLY A 303 4.499 -2.217 -1.594 1.00 0.00 O ATOM 0 H GLY A 303 2.701 -3.786 -1.625 1.00 0.00 H new ATOM 0 HA2 GLY A 303 5.077 -5.165 -0.569 1.00 0.00 H new ATOM 0 HA3 GLY A 303 4.858 -5.113 -2.307 1.00 0.00 H new ATOM 1205 N HIS A 304 6.529 -3.119 -1.234 1.00 0.00 N ATOM 1206 CA HIS A 304 7.222 -1.836 -1.243 1.00 0.00 C ATOM 1207 C HIS A 304 7.443 -1.349 -2.672 1.00 0.00 C ATOM 1208 O HIS A 304 7.932 -2.091 -3.524 1.00 0.00 O ATOM 1209 CB HIS A 304 8.563 -1.951 -0.518 1.00 0.00 C ATOM 1210 CG HIS A 304 8.453 -1.824 0.970 1.00 0.00 C ATOM 1211 ND1 HIS A 304 9.328 -2.432 1.845 1.00 0.00 N ATOM 1212 CD2 HIS A 304 7.563 -1.150 1.737 1.00 0.00 C ATOM 1213 CE1 HIS A 304 8.980 -2.141 3.086 1.00 0.00 C ATOM 1214 NE2 HIS A 304 7.913 -1.363 3.048 1.00 0.00 N ATOM 0 H HIS A 304 7.136 -3.925 -1.082 1.00 0.00 H new ATOM 0 HA HIS A 304 6.598 -1.110 -0.722 1.00 0.00 H new ATOM 0 HB2 HIS A 304 9.016 -2.913 -0.760 1.00 0.00 H new ATOM 0 HB3 HIS A 304 9.236 -1.179 -0.891 1.00 0.00 H new ATOM 0 HD2 HIS A 304 6.733 -0.556 1.384 1.00 0.00 H new ATOM 0 HE1 HIS A 304 9.482 -2.481 3.979 1.00 0.00 H new ATOM 0 HE2 HIS A 304 7.428 -0.982 3.860 1.00 0.00 H new ATOM 1222 N VAL A 305 7.079 -0.096 -2.928 1.00 0.00 N ATOM 1223 CA VAL A 305 7.238 0.491 -4.253 1.00 0.00 C ATOM 1224 C VAL A 305 8.672 0.346 -4.750 1.00 0.00 C ATOM 1225 O VAL A 305 8.930 -0.323 -5.752 1.00 0.00 O ATOM 1226 CB VAL A 305 6.853 1.982 -4.257 1.00 0.00 C ATOM 1227 CG1 VAL A 305 7.049 2.581 -5.641 1.00 0.00 C ATOM 1228 CG2 VAL A 305 5.418 2.163 -3.786 1.00 0.00 C ATOM 0 H VAL A 305 6.672 0.532 -2.235 1.00 0.00 H new ATOM 0 HA VAL A 305 6.568 -0.051 -4.921 1.00 0.00 H new ATOM 0 HB VAL A 305 7.508 2.510 -3.564 1.00 0.00 H new ATOM 0 HG11 VAL A 305 6.772 3.635 -5.624 1.00 0.00 H new ATOM 0 HG12 VAL A 305 8.095 2.486 -5.934 1.00 0.00 H new ATOM 0 HG13 VAL A 305 6.421 2.052 -6.358 1.00 0.00 H new ATOM 0 HG21 VAL A 305 5.163 3.223 -3.795 1.00 0.00 H new ATOM 0 HG22 VAL A 305 4.746 1.622 -4.452 1.00 0.00 H new ATOM 0 HG23 VAL A 305 5.316 1.774 -2.773 1.00 0.00 H new